<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">12051</id>
  <title nil="true"/>
  <common-name>Benzenamine, N,N'-methanetetraylbis(2,6-bis(1-methylethyl)-</common-name>
  <description>Benzenamine, N,N'-methanetetraylbis(2,6-bis(1-methylethyl)- is an organic compound with the formula C25H34N2 and an average molecular weight of 362.56 g/mol. Benzenamine, N,N'-methanetetraylbis(2,6-bis(1-methylethyl)- belongs to the cumenes, a subclass of benzene and substituted derivatives within the organic compounds.

Industrially, this substance is utilized as a heat stabilizer. It has been identified in three recorded sources, including drinking water and water supply systems, as well as electrical and electronic equipment such as radio transmission systems and antennas. The recorded route of exposure for this compound is oral.</description>
  <cas>2162-74-5</cas>
  <pubchem-id>75100</pubchem-id>
  <chemical-formula>C25H34N2</chemical-formula>
  <weight>362.5</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2016-05-19T03:30:31Z</created-at>
  <updated-at type="dateTime">2026-04-17T16:04:17Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CC(C)C1=CC=CC(C(C)C)=C1N=C=NC1=C(C=CC=C1C(C)C)C(C)C</moldb-smiles>
  <moldb-formula>C25H34N2</moldb-formula>
  <moldb-inchi>InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3</moldb-inchi>
  <moldb-inchikey>XLDBGFGREOMWSL-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">362.561</moldb-average-mass>
  <moldb-mono-mass type="decimal">362.272199103</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>67651</chemspider-id>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM010946</chemdb-id>
  <dsstox-id>DTXSID5051862</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin>REACH</stoff-ident-origin>
  <stoff-ident-id>SI00007914</stoff-ident-id>
  <susdat-id>NS00007917</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>24.72</moldb-polar-surface-area>
  <moldb-refractivity>120.63879999999996</moldb-refractivity>
  <moldb-polarizability>44.13459812410298</moldb-polarizability>
  <moldb-rotatable-bond-count>6</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>-2.1794511778377768</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>2</moldb-number-of-rings>
  <moldb-alogps-logp>7.17</moldb-alogps-logp>
  <moldb-alogps-logs>-6.43</moldb-alogps-logs>
  <moldb-alogps-solubility>1.36e-04 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Cumenes</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0080274</sync-id>
  <structure-inchikey>XLDBGFGREOMWSL-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000000000000040000000000000000000000000000400000000001000000000000000000000000000020000000000000000000000000000000000000000000004000200000000000000000020000000000004000000000000000000000000000002000000000000000000000000000000800000000000000001000040000000800000000000000000000000000000000000000000000000000000000000000000000000080000000010000000000000000000000000000000000000000000000008000000000000400000000000000200000200000000000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>501440000912824081000b60012820000000140001052000003520c08220084c44020090118000000100410800c0800004600224408c32010024743100a04080c7110c0012800400009010c0107202000804058051211b3240040462400240040c2005270048020040000400cd940000208680500901c0045138004002510002104000084ff0820808060254082c0008191c0812440014821000082000400080000310100090c00002000860017c25100ac0000289410840100042100cc00212a00000a404d0003201800400141102800c010000020050000d00020008000300901048100a8500000000000150122080001000308042040e0108100052000402</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`������@(������@h�������@h�������@h�������@(�������`�������`�������`������@(�������(�������(�������(������@(������@(������@h�������@h�������@h�������@(�������`�������`�������`�������`�������`�������`�����������������h���h���h���h�����	��
���h��� �(��(��� ��h���h���h���h���h���������������������h���h�B����������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:04:41Z</structure-indexed-at>
</compound>
